orbital_charges     :real:2:9,4
  0.446683942094937E+000  0.942010614476300E-001  0.942010442052241E-001
  0.942008924320390E-001  0.949921849438055E+000  0.949921856728395E+000
  0.960459493051283E+000  0.949921848574365E+000  0.960459490909858E+000
  0.446683889880818E+000  0.942010601199133E-001  0.942010409369148E-001
  0.942008910411129E-001  0.949921848117445E+000  0.949921850469638E+000
  0.960459492827463E+000  0.949921843480820E+000  0.960459486124470E+000
  0.446683889880815E+000  0.942010584905838E-001  0.942010427218762E-001
  0.942008908854815E-001  0.949921844202917E+000  0.949921850328044E+000
  0.960459489875925E+000  0.949921847536941E+000  0.960459489076007E+000
  0.446683894627598E+000  0.942010609546717E-001  0.942010435566347E-001
  0.942008881309074E-001  0.949921844812111E+000  0.949921854317860E+000
  0.960459491618444E+000  0.949921844090013E+000  0.960459487788868E+000
forces              :real:2:3,4
  0.209231257164433E-005  0.209696498509881E-005  0.209652435241570E-005
 -0.208869686442459E-005 -0.209262653612374E-005  0.208857179845312E-005
 -0.208869729470540E-005  0.208901110701487E-005 -0.209218625144003E-005
  0.208508158745790E-005 -0.209334955598994E-005 -0.209290989940103E-005
mermin_energy       :real:0:
 -0.553728761109291E+001
end_coords          :real:2:3,4
  0.392855135765672E-003  0.392496087827842E-003  0.392552779607500E-003
  0.314579249796886E+001  0.314579264914694E+001  0.392647265906929E-003
  0.314579251686612E+001  0.392628368647043E-003  0.314579264914694E+001
  0.392779546726129E-003  0.314579259245516E+001  0.314579259245516E+001
